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SIMM · NJU
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·
SIMM · NJU
Compound
PGDB_C001301
10 activity records
2 related patents
2D structure
O=C1CCC(N2Cc3cc(C(=O)c4ccccc4)ccc3C2=O)C(=O)N1
Compound summary
Compound ID
PGDB_C001301
Formula
C20H16N2O4
Molecular weight
348.358
InChIKey
ZDHUXJPMJJXHCH-UHFFFAOYSA-N
Physicochemical properties
Exact mass
348.111
RDKit cLogP
1.68
TPSA
83.5
HBD / HBA
1 / 4
Rotatable bonds
3
Heavy atoms
26
Hetero atoms
6
Rings / aromatic
4 / 2
Fraction Csp3
0.2
Formal charge
0
Fragments
1
Activity compounds and values
Activity records
10 records
Structure
Metric
Control
Relation
Value
Unit
Concentration
Time
Target
E3
Cell line
Patent
Record ID
Compound
Assay
Details
GI50
-
=
0.1-1
nM
-
—
GSPT1
-
Jurkat
KR20250075510A
PGDB_A012204
PGDB_C001301
PGDB_AS000013
View
% Degradation
-
=
70-90
%
10 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A014952
PGDB_C001301
PGDB_AS001448
View
% Degradation
-
=
30-50
%
0.1 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A027617
PGDB_C001301
PGDB_AS002288
View
GI50
-
=
0.1-1
uM
-
—
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A033430
PGDB_C001301
PGDB_AS001887
View
% Degradation
-
=
70-90
%
10 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A037177
PGDB_C001301
PGDB_AS001994
View
% Degradation
-
=
50-70
%
1 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A053374
PGDB_C001301
PGDB_AS001008
View
Relative binding
Ctrl @ 5uM
<
10
%
5 uM
1 h
CRBN
CRBN
HEK293
WO2025110699A1
PGDB_A054824
PGDB_C001301
PGDB_AS001966
View
Relative binding
Ctrl @ 5uM
<
10
%
5 uM
1 h
CRBN
CRBN
HEK-293
KR20250075510A
PGDB_A064218
PGDB_C001301
PGDB_AS000026
View
% Degradation
-
=
30-50
%
0.1 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A064229
PGDB_C001301
PGDB_AS001067
View
% Degradation
-
=
50-70
%
1 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A077106
PGDB_C001301
PGDB_AS000601
View